Basic information
- Standard SMILES
CN1CCC(c2c[nH]c3ccc(NC(=O)c4ccsc4)nc23)CC1- InChIKey
MFHQYQOIPCWNJA-UHFFFAOYSA-N- Molecular formula
- C18H20N4OS
- Average molar mass
- 340.4 g/mol
Names & identifiers
- Preferred name
- 5-(N-[3-thiophenecarbonyl]amino)-3-(1-methylpiperidin-4-yl)pyrrolo[3,2-b]pyridine
- IUPAC
- N-[3-(1-methylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]thiophene-3-carboxamide
Names & synonyms
CHEMBL104753SCHEMBL7006910MFHQYQOIPCWNJA-UHFFFAOYSA-NBDBM501304475-(N-[3-thiophenecarbonyl]amino)-3-(1-methylpiperidin-4-yl)pyrrolo[3,2-b]pyridineThiophene-3-carboxylic acid [3-(1-methyl-piperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-amide
Database identifiers
- PubChem CID
- 11046087
- ChEMBL
CHEMBL104753
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
Related reactions
4 records
Linked notes
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